4-Methyl-m-anisic acid
TL;DR: 4-Methyl-m-anisic acid (CAS 7151-68-0) is a chemical compound with molecular formula C9H10O3 and molecular weight 166.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-4-methylbenzoic acid
Also Known As: 3-Methoxy-4-methylbenzoic acid, 4-Methyl-m-anisic acid, 3-Methoxy-p-toluic acid, Benzoic acid, 3-methoxy-4-methyl-, 3-Methoxy-4-methylbenzoicacid
| Molecular Formula | C9H10O3 |
|---|---|
| Molecular Weight | 166.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.06299 |
| Heavy Atoms | 12 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 7151-68-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)O)OC |
| InChIKey | CEAVPXDEPGAVDA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methyl-m-anisic acid (CAS 7151-68-0), with molecular formula C9H10O3 and molecular weight 166.06 g/mol. IUPAC: 3-methoxy-4-methylbenzoic acid.
Chemical Property Profile of 4-Methyl-m-anisic acid
Property Insights of 4-Methyl-m-anisic acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-m-anisic acid. With a topological polar surface area (TPSA) of 46.5 Ų, 4-Methyl-m-anisic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-m-anisic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Methyl-m-anisic acid?
The CAS number of 4-Methyl-m-anisic acid is 7151-68-0.
What is the molecular formula of 4-Methyl-m-anisic acid?
The molecular formula of 4-Methyl-m-anisic acid is C9H10O3.
What is the molecular weight of 4-Methyl-m-anisic acid?
The molecular weight of 4-Methyl-m-anisic acid is 166.06 g/mol.
Where can I buy 4-Methyl-m-anisic acid?
You can request a quote for 4-Methyl-m-anisic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-m-anisic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-m-anisic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.